Clodinafop-propargyl

The IUPAC name of Clodinafop Propargyl is prop-2-ynyl (2R)-2-[4-(5-chloro-3-fluoropyridin-2-yl)oxyphenoxy]propanoate. With the CAS registry number 105512-06-9, it is also named as Propanoic acid, 2-(4-((5-chloro-3-fluoro-2-pyridinyl)oxy)phenoxy)-, 2-propynyl ester, (2R)-. The product's categories are Alpha Sort; CI - CL Pesticides & Metabolites; Herbicides; Pesticides & Metabolites; Phenoxy Structure. In addition, this chemical should be stored at the temperature of 0-6 °C.

The other characteristics of Clodinafop Propargyl can be summarized as: (1)ACD/LogP: 2.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.33; (4)ACD/LogD (pH 7.4): 2.33; (5)ACD/BCF (pH 5.5): 34.44; (6)ACD/BCF (pH 7.4): 34.44; (7)ACD/KOC (pH 5.5): 438.37; (8)ACD/KOC (pH 7.4): 438.37; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Index of Refraction: 1.558; (13)Molar Refractivity: 85.08 cm³; (14)Molar Volume: 263.5 cm³; (15)Polarizability: 33.72×10^-24 cm³; (16)Surface Tension: 47.5 dyne/cm; (17)Enthalpy of Vaporization: 68.85 kJ/mol; (18)Vapour Pressure: 1.09E-07 mmHg at 25°C; (19)Rotatable Bond Count: 7; (20)Exact Mass: 349.051714; (21)MonoIsotopic Mass: 349.051714; (22)Topological Polar Surface Area: 57.6; (23)Heavy Atom Count: 24; (24)Complexity: 461; (25)Defined Atom StereoCenter Count: 1.

When you are using this chemical, please be cautious about it as the following:
It is not only harmful by inhalation and if swallowed, but also very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. And it may cause sensitization by skin contact. If you want to contact this product, you must wear suitable protective clothing and gloves. This material and its container must be disposed of as hazardous waste. Avoid release to the environment. Refer to special instructions / safety data sheets.

People can use the following data to convert to the molecule structure. 
1. SMILES:O=C(OCC#C)[C@H](Oc2ccc(Oc1ncc(Cl)cc1F)cc2)C
2. InChI:InChI=1/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1 
3. InChIKey:JBDHZKLJNAIJNC-LLVKDONJBQ